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canSAR784772
FEATURES
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NAMES
    SMILES
    COC(=O)[C@@H]1C[C@H]2c3ccccc3N3C(=N)[C@](Cc4ccccc4)(N4CCCC4)N1[C@@H]23
    InChI
    InChI=1S/C25H28N4O2/c1-31-23(30)21-15-19-18-11-5-6-12-20(18)28-22(19)29(21)25(24(28)26,27-13-7-8-14-27)16-17-9-3-2-4-10-17/h2-6,9-12,19,21-22,26H,7-8,13-16H2,1H3/t19-,21-,22-,25+/m0/s1
    MOLECULAR FORMULA
    C25H28N4O2
    CROSS REFERENCES
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    canSAR784772

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 416.22
    AlogP 3.19
    HBond donors 1
    HBond acceptors 6
    Atoms 59
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR784772.